Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO745 | Rubus trifidus | Species | Rosaceae | Eukaryota | UNPD* | |||
NPO726 | Echinacea angustifolia | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO16552 | Aromia moschata | Species | Cerambycidae | Eukaryota | UNPD* | |||
NPO3939 | Ardisia arborescens | Species | Primulaceae | Eukaryota | UNPD* | |||
NPO14126 | Garcinia oligantha | Species | Clusiaceae | Eukaryota | UNPD* | |||
NPO13926 | Protaetia cuprea | Species | Scarabaeidae | Eukaryota | UNPD* | |||
NPO9962 | Pocillopora damicornis | Species | Pocilloporidae | Eukaryota | UNPD* | |||
NPO16877 | Aconitum episcopale | Species | Ranunculaceae | Eukaryota | UNPD* | |||
NPO7909 | Parmelia vittata | Species | Parmeliaceae | Eukaryota | UNPD* | |||
NPO15902 | Iris spuria | Species | Iridaceae | Eukaryota | UNPD* | |||
NPO16119 | Eucalyptus hybrid | Species | Myrtaceae | Eukaryota | UNPD* | |||
NPO6336 | Asarum sieboldii | Species | Aristolochiaceae | Eukaryota | roots |
PMID[22381047] |
||
NPO3741 | Pagrus major | Species | Sparidae | Eukaryota | UNPD* | |||
NPO15193 | Cacia concinna | NA | NA | NA | UNPD* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT2 | Others | Unspecified | IC50 | = | 6400 | nM | 22381047 | |
NPT2 | Others | Unspecified | EC50 | = | 58600 | nM | 22381047 | |
NPT866 | Individual Protein | Peroxisome proliferator-activated receptor alpha | Homo sapiens | EC50 | = | 46100 | nM | 22381047 |
NPT99 | Individual Protein | Peroxisome proliferator-activated receptor gamma | Homo sapiens | EC50 | = | 52300 | nM | 22381047 |
NPT106 | Individual Protein | Peroxisome proliferator-activated receptor delta | Homo sapiens | EC50 | = | 51100 | nM | 22381047 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules. Tc lies between [0, 1] where '1' indicates the highest similarity. What is Tanimoto coefficient
●  The left chart: Distribution of similarity level between NPC54542 and all remaining natural products in the NPASS database.
●  The right table: Most similar natural products (Tc>=0.56 or Top200).
Similarity Score | Similarity Level | Natural Product ID |
---|---|---|
1.0 | High Similarity | NPC243539 |
1.0 | High Similarity | NPC145032 |
1.0 | High Similarity | NPC267340 |
1.0 | High Similarity | NPC304223 |
0.9787 | High Similarity | NPC267692 |
0.9787 | High Similarity | NPC307435 |
0.9592 | High Similarity | NPC119655 |
0.9592 | High Similarity | NPC303672 |
0.94 | High Similarity | NPC56028 |
0.94 | High Similarity | NPC167759 |
0.94 | High Similarity | NPC305288 |
0.94 | High Similarity | NPC163912 |
0.9388 | High Similarity | NPC195986 |
0.9216 | High Similarity | NPC273023 |
0.9216 | High Similarity | NPC471991 |
0.9216 | High Similarity | NPC297020 |
0.9216 | High Similarity | NPC471992 |
0.9038 | High Similarity | NPC261158 |
0.9038 | High Similarity | NPC24216 |
0.9038 | High Similarity | NPC104138 |
0.9038 | High Similarity | NPC306420 |
0.9038 | High Similarity | NPC477049 |
0.902 | High Similarity | NPC44193 |
0.902 | High Similarity | NPC246519 |
0.902 | High Similarity | NPC14234 |
0.902 | High Similarity | NPC132669 |
0.902 | High Similarity | NPC184014 |
0.902 | High Similarity | NPC123669 |
0.902 | High Similarity | NPC269800 |
0.8393 | Intermediate Similarity | NPC6795 |
0.8302 | Intermediate Similarity | NPC13011 |
0.8302 | Intermediate Similarity | NPC124382 |
0.8214 | Intermediate Similarity | NPC312826 |
0.82 | Intermediate Similarity | NPC91044 |
0.8182 | Intermediate Similarity | NPC245650 |
0.7797 | Intermediate Similarity | NPC471023 |
0.7705 | Intermediate Similarity | NPC187315 |
0.7667 | Intermediate Similarity | NPC253468 |
0.7667 | Intermediate Similarity | NPC235311 |
0.7586 | Intermediate Similarity | NPC74617 |
0.7586 | Intermediate Similarity | NPC150505 |
0.7541 | Intermediate Similarity | NPC477525 |
0.75 | Intermediate Similarity | NPC77891 |
0.7419 | Intermediate Similarity | NPC315141 |
0.7419 | Intermediate Similarity | NPC129995 |
0.74 | Intermediate Similarity | NPC86121 |
0.74 | Intermediate Similarity | NPC470439 |
0.7368 | Intermediate Similarity | NPC4881 |
0.7333 | Intermediate Similarity | NPC324077 |
0.7167 | Intermediate Similarity | NPC309877 |
0.7167 | Intermediate Similarity | NPC130807 |
0.7077 | Intermediate Similarity | NPC471022 |
0.7049 | Intermediate Similarity | NPC273614 |
0.6833 | Remote Similarity | NPC210999 |
0.6792 | Remote Similarity | NPC299114 |
0.6774 | Remote Similarity | NPC29468 |
0.6765 | Remote Similarity | NPC314678 |
0.6667 | Remote Similarity | NPC182758 |
0.661 | Remote Similarity | NPC242930 |
0.6604 | Remote Similarity | NPC138935 |
0.6418 | Remote Similarity | NPC249713 |
0.629 | Remote Similarity | NPC325734 |
0.629 | Remote Similarity | NPC321030 |
0.6226 | Remote Similarity | NPC206906 |
0.619 | Remote Similarity | NPC329003 |
0.619 | Remote Similarity | NPC326524 |
0.619 | Remote Similarity | NPC325550 |
0.6184 | Remote Similarity | NPC14326 |
0.6102 | Remote Similarity | NPC208638 |
0.6087 | Remote Similarity | NPC103712 |
0.6087 | Remote Similarity | NPC45060 |
0.6087 | Remote Similarity | NPC280065 |
0.6087 | Remote Similarity | NPC291196 |
0.6071 | Remote Similarity | NPC180575 |
0.6038 | Remote Similarity | NPC269823 |
0.6 | Remote Similarity | NPC313911 |
0.6 | Remote Similarity | NPC314854 |
0.5962 | Remote Similarity | NPC15934 |
0.5962 | Remote Similarity | NPC182840 |
0.5962 | Remote Similarity | NPC29091 |
0.5962 | Remote Similarity | NPC103213 |
0.5962 | Remote Similarity | NPC255042 |
0.5932 | Remote Similarity | NPC261571 |
0.5926 | Remote Similarity | NPC213538 |
0.5926 | Remote Similarity | NPC256766 |
0.5909 | Remote Similarity | NPC477106 |
0.5909 | Remote Similarity | NPC316674 |
0.5849 | Remote Similarity | NPC56917 |
0.5849 | Remote Similarity | NPC145077 |
0.5833 | Remote Similarity | NPC188341 |
0.5833 | Remote Similarity | NPC49494 |
0.5818 | Remote Similarity | NPC116934 |
0.58 | Remote Similarity | NPC58957 |
0.5763 | Remote Similarity | NPC291437 |
0.5763 | Remote Similarity | NPC328784 |
0.5753 | Remote Similarity | NPC288086 |
0.575 | Remote Similarity | NPC3210 |
0.5676 | Remote Similarity | NPC476923 |
0.5667 | Remote Similarity | NPC71053 |
0.5667 | Remote Similarity | NPC59408 |
0.5667 | Remote Similarity | NPC43053 |
0.5636 | Remote Similarity | NPC68889 |
0.5636 | Remote Similarity | NPC51758 |
0.5636 | Remote Similarity | NPC209279 |
0.5636 | Remote Similarity | NPC304151 |
0.5636 | Remote Similarity | NPC88079 |
0.5636 | Remote Similarity | NPC108494 |
0.5636 | Remote Similarity | NPC180871 |
0.5636 | Remote Similarity | NPC67761 |
0.5636 | Remote Similarity | NPC194586 |
0.5614 | Remote Similarity | NPC160628 |
0.5614 | Remote Similarity | NPC269074 |
0.5614 | Remote Similarity | NPC140501 |
0.561 | Remote Similarity | NPC473031 |
0.56 | Remote Similarity | NPC250734 |
0.56 | Remote Similarity | NPC263266 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC54542 and all drugs/candidates.
●  The right table: Most similar clinical/approved drugs (Tc>=0.56 or Top200).
PubChem CID   | 70693621 |
ChEMBL   | CHEMBL2011545 |
ZINC   |
Molecular Weight:   | 247.19 |
ALogP:   | 2.9939 |
MLogP:   | 3 |
XLogP:   | 5.17 |
# Rotatable Bonds:   | 12 |
Polar Surface Area:   | 32.59 |
# H-Bond Aceptor:   | 2 |
# H-Bond Donor:   | 1 |
# Rings:   | 0 |
# Heavy Atoms:   | 18 |